./iterations/neb1_max2_image01_iter86_CONTCAR output for 41: 3.3A-->1.3A (Job 121) O-H...N hydrogen bond by TSA-OH, TSA-NH2 (TSS)

Status: finished

No title                                
   1.00000000000000     
    15.0000000000000000    0.0000000000000000    0.0000000000000000
     0.0000000000000000   12.0000000000000000    0.0000000000000000
     0.0000000000000000    0.0000000000000000   12.0000000000000000
   N    Si   O    H 
     3     6     1    19
Direct
  0.0775120300000012  0.9809620899999985  0.6415757600000020
  0.9603613399999986  0.6560352699999967  0.7815261499999977
  0.4744251600000027  0.4158564600000005  0.4351259399999989
  0.0871587700000021  0.3134577699999994  0.7706249499999984
  0.2527716000000026  0.0608391199999971  0.4914802999999992
  0.4346646899999982  0.1201691099999991  0.8363971799999987
  0.1898309199999986  0.0115931500000030  0.8169329999999988
  0.7961512400000004  0.1168582700000016  0.5853424299999972
  0.0273963699999982  0.7605111700000009  0.3308431399999989
  0.1468877800000001  0.4400264300000032  0.3899522800000028
  0.0920359799999986  0.6249937700000032  0.3048148299999980
  0.5080465300000014  0.6554526400000000  0.1763805800000000
  0.3424565700000031  0.1347269500000010  0.3984689700000033
  0.8430348600000031  0.8959169399999993  0.8127441500000003
  0.1142722900000024  0.8053320699999986  0.0588446000000005
  0.2748350600000009  0.7441215699999972  0.3387207700000019
  0.2988723100000001  0.5511684499999987  0.7372566100000029
  0.6731484399999985  0.7578215699999973  0.8331678400000015
  0.9977922400000026  0.3165893400000002  0.5362634700000015
  0.8294742599999978  0.1985013700000025  0.6348999499999977
  0.6671807500000000  0.3154394399999987  0.4648761300000004
  0.7826170700000006  0.1835078399999972  0.3697879899999990
  0.0299905800000033  0.9067408000000015  0.7518958400000031
  0.8188649699999999  0.3519530599999996  0.7788438400000004
  0.8860473700000000  0.7807443000000021  0.6886183000000017
  0.4961475599999972  0.8141044600000029  0.7395584400000033
  0.4572951800000027  0.6599095899999980  0.7365743499999979
  0.8515122800000015  0.0107322400000029  0.3504010899999983
  0.5545008899999999  0.2066989599999971  0.3144931599999978
 
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00